Vitas-M small molecule compound

N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-2-nitrobenzenesulfonamide

Catalog ID
STK013900
SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H11N3O6S3 MW 413.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O6S3/c1-25(20,21)9-6-7-10-12(8-9)24-14(15-10)16-26(22,23)13-5-3-2-4-11(13)17(18)19/h2-8H,1H3,(H,15,16)
InChIKey
PNPOBRMXGJWRLW-UHFFFAOYSA-N
Synonyms
349623-12-7
(O)(N+)(=O)c1ccccc1S(=O)(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C
CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC14H11N3O6S3c125(2021)9671012(89)2414(1510)1626(2223)13532411(13)17(18)19h28H1H3(H1516)
MFCD01336605
N((2Z)6(METHYLSULFONYL)13BENZOTHIAZOL2(3H)YLIDENE)2NITROBENZENESULFONAMIDE
N(6(METHYLSULFONYL)13BENZOTHIAZOL2YL)2NITROBENZENESULFONAMIDE
N(6(methylsulfonyl)benzo(d)thiazol2yl)2nitrobenzenesulfonamide
N(6METHYLSULFONYL13BENZOTHIAZOL2YL)2NITROBENZENESULFONAMIDE
STK013900
ZINC000002209832
ZINC02209832
ZINC2209832

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.